[1-[(1-cyano-2-phenylmethoxy-ethyl)amino]-4-cyclohexyl-4-methyl-1-oxidanylidene-pentan-2-yl] morpholine-4-carboxylate

Systemtic Name: [1-[(1-cyano-2-phenylmethoxy-ethyl)amino]-4-cyclohexyl-4-methyl-1-oxidanylidene-pentan-2-yl] morpholine-4-carboxylate Openeye Name: [1-[(2-benzyloxy-1-cyano-ethyl)carbamoyl]-3-cyclohexyl-3-methyl-butyl] morpholine-4-carboxylate CAS Name: 4-morpholinecarboxylic acid [1-[(1-cyano-2-phenylmethoxyethyl)amino]-4-cyclohexyl-4-methyl-1-oxopentan-2-yl] ester IUPAC Name: [1-[(1-cyano-2-phenylmethoxyethyl)amino]-4-cyclohexyl-4-methyl-1-oxopentan-2-yl] morpholine-4-carboxylate Traditional Name: morpholine-4-carboxylic acid [1-[(2-benzoxy-1-cyano-ethyl)carbamoyl]-3-cyclohexyl-3-methyl-butyl] ester Formula: C27H39N3O5 MolecularWeight: 485.61566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(C(=O)NC(COCC1=CC=CC=C1)C#N)OC(=O)N2CCOCC2)C3CCCCC3

Isomeric SMILES

CC(C)(CC(C(=O)NC(COCC1=CC=CC=C1)C#N)OC(=O)N2CCOCC2)C3CCCCC3

InChI

InChI=1S/C27H39N3O5/c1-27(2,22-11-7-4-8-12-22)17-24(35-26(32)30-13-15-33-16-14-30)25(31)29-23(18-28)20-34-19-21-9-5-3-6-10-21/h3,5-6,9-10,22-24H,4,7-8,11-17,19-20H2,1-2H3,(H,29,31)